NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 A 4.3201 8.2649 123.5826 51.4949 20.6742 177.5270 6 P 4.2295 0.0000 0.0000 61.3607 32.1995 174.6672 7 D 4.6076 9.1194 121.8643 52.1972 44.3659 175.4346 8 R 3.7621 8.7471 124.6169 59.8074 30.0775 177.9849 9 E 3.9881 8.3141 119.4453 60.4842 29.8614 180.4911 10 K 3.9461 8.0718 122.4717 59.9206 31.7401 180.7911 11 A 4.2253 8.5220 122.7298 54.9213 18.1021 179.5740 12 L 4.0423 8.4935 119.1957 58.0800 42.1610 178.9615 13 E 3.9477 8.1958 118.5762 59.6202 29.0936 179.3764 14 L 4.1695 7.8961 118.3094 57.4706 41.4568 179.6373 15 A 4.0344 7.5400 119.4933 55.2541 18.5380 179.1446 16 M 3.9469 8.2828 117.0867 58.6916 32.0519 178.5569 17 A 3.9859 8.4872 120.8778 55.7229 18.4800 179.5684 18 Q 3.8522 7.8097 116.9148 59.1281 28.9741 178.5088 19 I 3.7872 7.9871 121.2854 64.6543 37.0771 178.1775 20 D 4.8167 8.4330 121.3910 56.7766 40.4026 178.8072 21 K 3.9385 8.1274 119.5865 59.2302 32.2144 178.2952 22 N 4.2511 7.9439 116.2126 54.8491 38.6608 176.3974 23 F 4.9599 8.2105 115.9843 55.8038 41.0132 176.3755 24 G 4.0470 8.5457 107.6252 44.7816 0.0000 173.5591 25 K 4.4248 7.7982 120.7074 57.3555 32.4085 177.4223 26 G 4.1593 9.4944 111.1872 46.2122 0.0000 174.5856 27 S 4.2890 8.0560 114.8213 60.9011 63.0977 175.0187 28 V 4.5808 7.4089 119.6998 60.3636 34.0815 173.5666 29 M 4.7373 8.2650 119.9621 53.6415 33.8271 174.6996 30 R 4.0819 8.5238 120.8777 56.3878 30.9746 177.8969 31 L 4.0279 8.6538 122.2024 57.9009 41.8057 178.7078 32 G 3.7617 7.9859 104.7799 46.3330 0.0000 173.3180 33 E 3.8981 7.4470 121.0430 56.6276 29.9932 176.2081 34 E 4.5285 8.4045 123.6438 54.2461 30.6674 176.1382 35 V 3.7570 8.4260 126.8067 63.5738 32.1647 176.5498 36 R 4.5585 8.5073 124.0269 55.9920 30.3913 173.9824 37 Q 4.3598 7.9748 119.3325 54.6048 28.1435 173.6123 38 P 4.4120 0.0000 0.0000 62.3385 31.3350 177.1089 39 I 4.2516 7.9616 121.4297 58.4091 37.2557 171.5853 40 S 4.6348 8.2853 114.2650 59.6341 63.8245 174.4165 41 V 5.0179 8.3276 116.5018 59.7066 36.3035 175.1343 42 I 4.3555 8.6238 122.2716 58.7716 39.4504 173.5243 43 P 4.6688 0.0000 0.0000 63.3496 31.5909 177.4933 44 T 3.8242 9.6572 118.9692 63.0631 67.4177 175.6740 45 G 3.6823 7.7912 107.8227 46.4275 0.0000 174.3738 46 S 4.1466 7.0986 113.4498 54.9207 63.6035 173.9142 47 I 3.7726 8.0962 129.4022 64.3757 36.9993 177.3871 48 S 4.1213 8.1299 114.0334 61.8214 62.5039 176.1730 49 L 4.0328 7.7202 124.5318 57.5936 41.8156 178.5428 50 D 4.3313 8.7206 119.3400 57.4935 40.7701 179.0726 51 V 3.6311 8.1315 118.6425 65.8104 31.3161 178.0048 52 A 4.0737 8.2329 120.2307 54.9761 18.2635 179.3024 53 L 4.0963 8.0582 117.1974 56.0000 41.7927 178.6214 54 G 4.0925 8.6264 106.1493 46.3456 0.0000 173.8895 55 I 4.4612 7.1662 110.1658 59.6834 38.4406 175.2028 56 G 3.7727 8.4077 108.0326 44.6127 0.0000 174.3064 57 G 4.2333 7.7227 106.2637 43.3594 0.0000 172.6676 58 L 4.4060 8.0739 120.8274 53.3232 42.5684 175.6431 59 P 4.7758 0.0000 0.0000 63.1949 31.9946 175.9602 60 R 4.6634 8.0825 121.5346 55.7939 31.0917 176.8743 61 G 3.9217 9.1776 110.6164 45.7248 0.0000 172.6971 62 R 4.8210 7.6282 116.8856 53.9122 35.0471 174.1997 63 V 4.6789 8.3054 120.1888 62.1283 33.2928 174.5882 64 I 5.1262 10.0125 128.6178 59.4590 40.9357 173.8887 65 E 5.1155 8.9711 126.7305 54.6573 32.5404 174.7092 66 I 4.9220 8.8320 127.8688 59.6374 39.0595 174.4589 67 Y 5.6897 9.0417 125.9201 54.4479 40.9781 174.7075 68 G 4.9286 8.7811 105.5405 43.2142 0.0000 170.9445 69 P 4.4880 0.0000 0.0000 62.6292 31.9312 176.9905 70 E 4.2318 8.3877 116.6722 57.5526 30.3899 178.8008 71 S 4.3401 8.9067 117.0556 58.4594 61.4311 171.5813 72 S 4.1638 7.5430 113.5916 59.6126 62.7245 175.2527 73 G 4.1379 8.4316 109.5762 45.2307 0.0000 175.4860 74 K 3.8354 8.3212 119.3781 60.4122 31.9382 178.6350 75 T 3.9778 8.0368 114.8143 67.1699 68.4121 176.6121 76 T 3.9816 8.0159 117.0546 66.5680 68.4820 176.5981 77 V 3.5391 7.9571 119.8257 65.9332 31.6076 177.4796 78 A 4.0252 8.1388 120.5992 55.6188 18.1299 179.6051 79 L 3.9477 8.2980 117.3009 58.3193 41.6730 179.5406 80 H 4.1030 8.3196 115.9291 58.6458 28.5061 177.7533 81 A 4.0865 8.2611 122.7422 55.1736 18.2743 179.5332 82 V 3.4966 7.9227 116.6776 66.2634 31.4131 178.0244 83 A 3.9283 8.1430 120.2021 55.4356 17.8360 179.3242 84 N 4.2295 8.2003 114.6847 56.4561 38.4502 177.5401 85 A 4.0360 8.2154 122.4236 54.9735 18.3877 179.7912 86 Q 4.7027 8.3149 117.8170 58.6949 28.6078 178.4167 87 A 4.0006 8.0671 120.7043 55.1050 18.3929 178.5504 88 A 4.4252 7.6009 116.7456 52.1793 19.5948 177.4476 89 G 3.8996 8.1057 107.5534 48.1303 0.0000 174.6815 90 G 4.2845 7.8968 105.8636 44.5045 0.0000 173.5528 91 I 4.8042 8.3436 122.3515 59.5867 39.1117 174.5540 92 A 5.7419 8.8779 127.4912 49.2279 22.3065 174.6380 93 A 5.0315 8.4975 121.1260 50.0557 23.3442 175.2012 94 F 4.8111 9.2200 122.1189 56.5538 42.5906 174.3598 95 I 4.0037 8.8640 129.9955 60.4171 37.6937 174.1447 96 D 4.9711 9.2643 128.3169 52.7694 42.4808 176.1585 97 A 4.6932 8.1577 123.0799 51.6195 20.1142 176.1061 98 E 4.3277 8.4854 117.6595 56.6790 32.2712 175.7342 99 H 4.6798 9.4327 113.5523 56.7767 26.4246 175.2080 100 A 4.5728 8.0273 121.4301 52.3320 21.2645 177.6066 101 L 3.6566 7.9171 116.3142 56.0896 42.3572 176.7321 102 D 4.7624 8.4538 124.9761 51.5833 41.9077 174.2244 103 P 4.2043 0.0000 0.0000 65.9548 31.3051 178.0645 104 E 3.9811 8.2706 117.6293 59.2942 29.3950 178.4333 105 Y 4.2512 8.4955 119.5333 60.3472 38.7751 177.3754 106 A 3.8189 7.9805 121.9169 54.9541 18.3962 179.7934 107 K 4.1483 8.0181 118.4249 58.8244 31.8404 179.7140 108 K 3.8875 7.1688 117.1124 59.4175 32.1107 179.0436 109 L 3.9987 7.0975 116.6844 55.5997 41.4558 177.9977 110 G 4.0312 7.6074 107.3029 45.0806 0.0000 173.9321 111 V 3.8698 8.0419 120.3186 62.2684 31.9943 175.1151 112 D 4.8143 9.6819 128.0829 52.6357 39.9731 176.7482 113 T 3.8521 8.2349 115.9944 64.3733 69.0926 176.8817 114 D 4.2835 8.1458 120.6356 56.7843 40.8540 177.3018 115 S 4.4834 7.7082 112.0938 58.1919 63.1755 173.3982 116 L 4.5234 7.7966 124.6617 53.9328 42.4159 176.3930 117 L 4.2915 8.4274 127.5245 54.8209 42.8055 176.4097 118 V 5.0405 8.3415 122.3165 61.2742 34.6074 174.3512 119 S 4.7431 8.9793 120.7287 56.8800 66.2423 172.6633 120 Q 5.3864 8.4059 122.7526 51.7476 29.1836 172.8150 121 P 4.3319 0.0000 0.0000 63.0005 31.9854 176.0565 122 D 4.4935 8.9417 122.0913 56.8074 41.3539 176.9376 123 T 4.8716 7.4740 107.6144 58.8751 73.4674 174.8561 124 G 3.8049 8.4952 108.6874 47.3667 0.0000 175.7817 125 E 3.9794 8.1461 120.5025 59.1736 29.4153 178.9918 126 Q 3.9156 7.9478 118.7476 59.4000 29.0944 177.5929 127 A 4.2652 8.1162 121.4799 55.8627 18.2574 179.4814 128 L 3.9522 8.1662 116.1170 57.7151 41.7099 179.5091 129 E 3.9052 8.2745 119.0846 59.3626 29.6400 178.7876 130 I 3.6499 8.6384 120.6149 64.5696 37.2027 178.1536 131 A 3.9818 8.2431 121.6724 55.2888 18.0050 179.2390 132 D 4.2365 8.4094 116.8018 57.8425 41.1337 178.3748 133 M 4.1027 8.1182 118.3079 58.5398 32.1864 178.3406 134 L 4.0518 8.1634 119.3289 57.3475 41.8491 179.3797 135 V 3.5142 8.1100 118.6487 66.3760 31.6138 178.9172 136 R 4.1314 7.7416 112.4017 56.6166 28.6668 177.1155 137 S 4.4500 8.0330 112.8070 58.0256 63.8165 175.4350 138 G 3.8927 8.0093 108.3165 45.9751 0.0000 174.5523 139 A 4.1679 7.6178 122.1423 53.9977 18.9119 178.1843 140 L 4.6297 7.6541 114.9208 54.7560 43.0564 175.9379 141 D 4.7930 9.1337 121.4605 55.6661 43.1161 176.4427 142 I 5.0500 7.4799 116.6861 59.2556 42.1747 173.5492 143 I 5.0086 8.7868 127.0422 59.2032 41.7821 173.8298 144 V 4.6236 8.5699 128.0422 61.0232 34.5536 174.1490 145 I 4.2610 7.9795 128.6916 59.3846 37.9729 174.1623 146 D 4.4859 8.3885 128.8160 54.4236 42.3750 174.9953 147 S 3.9354 8.6486 120.1914 58.3456 61.3297 172.5593 148 V 3.4868 8.7332 128.0580 66.8701 31.8919 178.1958 149 A 3.9708 8.0584 120.6258 54.9521 18.3184 177.6231 150 A 4.4749 8.6945 118.0749 52.6288 18.4873 177.0494 151 L 4.4650 7.7656 117.2677 55.4306 42.1078 177.2573 152 V 3.8149 7.9346 112.0091 61.5400 32.0735 174.6306 153 P 5.0604 0.0000 0.0000 61.7261 33.1815 177.4956 154 R 3.8058 9.0108 119.3219 59.7843 29.9171 178.8179 155 A 4.1807 8.0572 118.2464 54.5819 18.2617 178.2907 156 E 4.2132 7.8180 116.3731 58.4871 30.3230 177.6965 157 I 3.8176 7.4485 118.7623 63.5893 37.7119 176.6483 158 E 4.0626 8.2390 118.7120 55.3957 29.8885 176.6367 159 G 3.7279 8.7167 111.8888 46.3292 0.0000 172.3729 160 E 4.6902 8.4207 126.6719 54.3474 33.0479 176.6028 161 M 4.2997 8.5244 119.3398 54.9535 31.9377 176.6857 162 G 4.1492 8.5162 105.9737 47.5415 0.0000 174.1029 163 D 4.8204 7.5601 119.5438 52.7289 43.6397 179.9279 164 S 4.0402 9.0003 117.4960 59.4667 59.9859 172.1085 *165 H 4.4564 7.6461 116.9767 55.3302 27.9640 179.5587 166 V 4.5850 7.9728 123.0290 58.0921 34.8288 176.7488 167 G 3.9262 8.2613 106.7777 44.4294 0.0000 174.2338 168 L 4.0421 7.5653 123.5758 58.0801 42.7900 177.6190 169 Q 3.9024 8.0877 119.1902 58.8405 29.0453 177.8439 170 A 3.9437 7.9071 121.2809 55.2730 18.6062 179.3972 171 R 3.8408 7.5931 115.8565 59.3763 30.2191 178.7723 172 L 3.8784 8.3942 120.2328 58.7270 41.9287 178.9093 173 M 4.0198 8.4185 118.1272 58.5722 32.0762 178.2231 174 S 4.1358 8.5467 115.9984 61.3704 63.1165 176.1150 175 Q 3.9660 8.6494 120.6178 59.2892 28.7399 179.3692 176 A 4.0535 7.9344 121.2044 55.2756 18.3072 179.7347 177 L 3.6243 7.4460 117.1816 57.5691 41.3210 179.3489 178 R 3.8673 7.2056 117.8851 59.6077 30.0563 178.0172 179 K 4.1783 7.6143 116.4594 59.5979 32.9016 178.7607 180 M 4.2170 7.9350 119.5481 58.4708 32.1819 177.9619 181 T 3.9979 8.1415 110.4388 65.1220 68.6683 176.4890 182 G 3.5937 8.1112 107.7873 47.2593 0.0000 175.3344 183 A 4.0280 7.6780 121.9304 54.9165 18.3970 179.5873 184 L 3.9778 8.5909 117.8321 57.9161 41.4491 179.3388 185 N 4.3791 7.9061 115.7738 56.8447 39.0728 176.1451 186 N 4.4738 7.9989 116.6586 56.6183 38.8077 177.3101 187 S 4.3448 8.5204 114.2908 58.9474 63.3652 174.4893 188 G 3.7918 8.4558 110.1089 46.7820 0.0000 172.9473 189 T 4.7339 7.4697 116.8531 61.7291 70.5816 174.7364 190 T 4.3218 9.2068 124.2409 63.4076 69.5719 173.5143 191 A 4.8093 9.6161 128.2828 50.3179 21.7298 174.8375 192 I 4.5883 8.3035 123.7711 60.5859 39.4078 175.1802 193 F 4.8312 9.5111 126.5891 55.6272 41.2448 175.0041 194 I 4.5106 8.6700 126.5368 60.9055 38.3138 174.7220 195 N 5.0752 9.1726 126.9578 51.9324 40.7809 173.5395 196 A 5.0919 8.7292 132.0089 50.7989 19.6166 176.7345 197 L 4.1712 8.4287 126.7786 56.7844 40.8889 175.6297 198 R 4.3774 8.7241 122.5368 55.9291 32.3500 173.2025 *209 E 4.1828 8.0546 112.8177 56.7769 31.5392 181.8512 210 T 4.1665 7.9546 114.8102 61.7637 66.0716 176.2475 211 T 3.6033 7.9776 119.5257 62.7621 65.7812 174.8213 212 T 3.8177 8.1745 118.8577 62.6148 66.7382 176.4661 213 G 3.9715 7.7192 107.1527 45.9513 0.0000 175.4859 214 G 4.1245 8.0801 111.2328 46.9264 0.0000 176.1533 215 K 3.9312 7.9760 125.0558 59.8683 32.0001 183.9214 216 A 4.5268 7.9727 121.3563 55.0057 18.5281 178.9292 217 L 3.8120 7.4465 117.6518 58.5222 41.7818 178.8663 218 K 3.6663 7.6694 117.8879 59.8642 32.0618 178.0171 219 F 4.3629 8.1409 115.5750 59.2906 39.1024 176.7426 220 Y 4.3842 7.8464 114.6318 58.1848 38.7335 176.0199 221 A 4.3624 8.1802 123.5055 52.5623 19.0422 177.5065 222 S 4.5246 9.0026 118.9890 60.2416 64.5821 174.5386 223 V 4.9319 7.6522 118.5208 61.1539 35.0079 174.2730 224 R 5.0597 8.9675 125.1647 54.5231 34.0216 173.9345 225 L 4.7285 9.1501 124.6116 53.1015 44.3364 175.5768 226 D 3.6929 8.6789 125.5800 52.8307 40.7000 174.0771 227 V 4.2006 8.0492 124.1279 61.9150 33.2411 174.4170 228 R 4.6828 8.5227 126.8949 54.6330 33.9418 173.6463 229 R 4.4764 8.6490 126.7068 56.2250 30.2298 175.7232 230 I 4.6102 8.6305 120.6913 61.5489 39.7680 175.7831 231 E 4.6966 7.9593 118.7431 55.5227 34.3901 179.1334 232 T 4.5773 8.3336 115.5527 60.4097 67.8711 173.5132 233 L 3.8856 8.1008 130.0224 56.4468 42.4711 178.3574 234 K 4.1684 8.9721 125.4011 55.6289 34.2112 174.2838 235 D 4.9901 8.7051 121.2518 52.8420 38.4875 175.4574 236 G 4.0302 7.4412 109.9155 45.5149 0.0000 173.3448 237 T 4.3535 8.2645 108.6874 57.6075 67.0365 169.8610 238 D 4.4161 7.5658 120.2075 52.1601 42.8252 176.6100 239 A 4.1269 8.7758 124.8954 52.7490 18.6670 175.8051 240 V 4.3591 8.0340 121.0220 63.4950 34.9185 174.9087 241 G 4.0680 7.4050 110.1701 45.5422 0.0000 170.5308 242 N 5.4419 9.2400 119.6943 52.0584 44.0334 173.4924 243 R 4.8110 8.8327 122.8906 55.4346 32.0426 175.5611 244 T 4.7944 8.7307 123.0008 62.0424 71.8251 173.8142 245 R 4.5292 8.5361 123.2319 54.9152 33.3139 173.8415 246 V 4.7348 8.6486 126.9836 61.0663 34.3046 174.2723 247 K 4.6958 8.4006 127.6743 54.6127 34.7875 175.7634 248 V 4.3044 8.6253 129.4174 62.2819 29.3193 176.5233 249 V 3.7060 8.1277 117.9662 63.0905 32.7350 176.2502 250 K 4.4212 7.8848 119.5503 54.7385 36.1613 175.5339 251 N 5.0876 8.2332 124.4714 52.9684 40.2812 173.8069 252 K 4.3113 9.8082 124.9861 56.4249 33.0387 178.4713 253 V 4.3856 8.0461 111.8960 60.3452 32.5607 174.6024 254 S 4.4841 7.3121 113.4633 57.0488 65.7858 173.2550 255 P 4.3397 0.0000 0.0000 61.7863 31.4034 175.0192 256 P 4.3728 0.0000 0.0000 62.3518 32.8594 175.7479 257 F 4.3831 9.1818 116.0646 57.3245 37.1583 175.5510 258 K 4.4951 7.6883 120.3217 56.3997 33.4879 175.7137 259 Q 5.1853 8.5501 119.2265 54.3239 32.4364 174.7130 260 A 4.9451 8.8488 123.1037 50.4210 23.0944 174.7763 261 E 4.9972 8.6630 117.6689 54.9001 33.8329 174.7938 262 F 4.9405 8.0220 115.9701 56.3006 41.9632 172.3184 263 D 5.3534 8.8273 119.0402 52.8925 43.6264 175.7229 264 I 4.9517 8.8164 123.1628 59.6123 40.3002 174.9852 265 L 4.7353 8.4340 128.8699 54.5090 43.2417 177.0531 *266 Y 4.1124 8.5489 123.3751 59.2037 36.7534 176.3753 267 G 4.3418 9.2365 113.6391 44.6018 0.0000 173.6045 268 Q 4.6660 7.6752 116.6230 53.9084 31.8510 176.0599 269 G 4.0474 7.9908 111.4685 45.3720 0.0000 173.4122 270 I 3.9010 8.6040 124.5671 61.0721 37.6900 175.6172 271 S 4.1278 8.9962 121.4261 58.1290 62.5132 174.3000 272 R 3.8007 8.5710 128.4110 59.4481 29.9040 177.7145 273 E 3.9720 8.2455 117.8559 59.5534 29.5137 179.4830 274 G 3.7095 8.5424 105.5919 48.7112 0.0000 174.9800 275 S 4.0670 8.2194 117.3840 61.3759 62.6351 176.8177 276 L 3.7540 8.3115 120.6236 58.4089 41.7867 179.7811 277 I 3.5631 8.0505 119.5066 65.2150 36.9045 177.7101 278 D 4.4057 8.1990 119.7161 57.3566 40.4990 178.4589 279 M 4.1591 9.1100 119.9187 58.4781 31.7609 179.4695 280 G 3.6748 9.0862 107.2262 48.2795 0.0000 175.2859 281 V 4.0904 8.1269 122.1586 64.8163 31.1771 177.4367 282 E 4.0189 8.1615 117.9130 60.0845 29.4752 178.2203 283 H 4.5025 8.1603 114.5332 55.7155 28.6598 176.3092 284 G 4.2470 8.3057 115.3396 46.7560 0.0000 176.1931 285 F 4.2620 7.2996 117.3422 58.6825 39.2906 175.7444 286 I 4.9800 7.9306 119.6211 59.1861 40.9796 174.6257 287 R 4.7456 9.4456 129.8419 55.1197 33.4107 175.8796 288 K 5.2731 8.4775 126.7826 52.5099 32.4685 174.9387 289 S 4.0709 8.6214 121.5917 58.5872 63.0494 175.1754 290 G 3.9221 8.1209 110.2527 46.7335 0.0000 173.3150 291 S 4.1829 8.8867 125.9933 58.5686 61.5113 170.4568 292 W 4.3217 7.7245 119.4173 56.2248 30.6169 174.8314 293 F 5.5903 8.6412 122.1868 56.2468 41.1582 174.9435 294 T 5.2370 9.3270 112.0109 60.6129 72.7707 172.0352 295 Y 4.9855 8.8150 123.3924 56.6076 42.2987 174.8573 296 E 3.4703 9.3974 128.2355 57.2281 28.0093 174.9383 297 G 3.9045 7.9255 101.9732 46.1360 0.0000 172.7384 298 E 4.5077 8.7567 121.0287 54.2791 30.8300 175.4353 299 Q 4.4861 8.6544 125.0207 56.1983 29.5634 175.2723 300 L 3.2802 9.9374 124.9719 55.3870 43.5520 175.7288 301 G 3.6944 7.5497 104.6611 43.6077 0.0000 172.8932 302 Q 3.6002 6.8230 120.8465 54.6787 28.7143 177.2153 303 G 4.0559 8.6509 111.3237 44.6752 0.0000 174.0109 304 K 3.5479 9.2957 125.4855 59.8347 31.8854 178.3692 305 E 3.9130 8.0641 118.0853 59.5092 29.6126 178.4971 306 N 4.0933 8.2103 115.7437 56.3899 38.5653 177.2017 307 A 4.1913 8.1912 123.4996 54.4951 18.2598 179.4390 308 R 3.8218 7.9499 118.8802 60.2312 30.4413 178.8498 309 K 3.9998 8.8133 124.3285 60.2572 31.6067 180.0183 310 F 3.9788 8.4289 121.5113 61.6810 39.0761 177.5562 311 L 4.2335 8.3174 120.3597 58.1325 41.4710 180.0800 312 L 4.1723 8.0115 122.3084 59.4341 41.0194 183.2943 313 E 4.3290 7.8813 118.2195 58.4036 30.8095 178.9141 314 N 4.5253 8.0480 121.2575 52.5276 36.3753 175.6886 315 T 4.1220 7.7897 117.1771 63.5828 67.5369 174.9873 316 D 4.5510 7.8729 120.6643 58.3579 41.0917 176.5971 317 V 3.9998 7.3193 115.5500 62.7386 34.7865 174.4132 318 A 4.0402 8.3695 124.8053 53.7633 17.3140 180.0420 319 N 4.2242 7.3157 113.0576 55.9543 38.6004 177.3180 320 E 4.0401 7.7203 120.4154 58.5880 29.6878 178.9114 321 I 3.3925 7.2568 119.6694 64.1995 37.3099 177.3876 322 E 3.7525 8.4737 120.6007 59.2105 29.3062 178.8627 323 K 3.9166 7.7818 119.2610 59.5730 32.4501 178.8361 324 K 3.8291 8.1914 118.9549 59.5722 31.6336 179.4358 325 I 3.5216 7.7597 121.8182 64.6094 36.9020 179.0208 326 K 4.1240 8.5968 124.9457 59.3393 31.5475 180.5912 327 E 4.2630 8.0733 117.9948 59.3084 29.4550 178.4815 328 K 4.1753 8.1245 119.7700 58.3660 32.5568 176.4330 329 L 4.4541 8.2618 114.6053 54.2418 44.2718 176.6103 330 G 3.9291 6.5722 116.6998 44.9698 0.0000 172.9134 331 I 4.6388 7.9664 123.2174 56.7318 39.4431 171.7559 332 G 3.6916 8.6668 105.6899 47.8979 0.0000 172.9566 333 A 4.5414 8.4663 128.7038 50.9570 21.8801 177.4690 334 V 3.7199 8.2852 114.9340 61.6257 31.6455 169.8650 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 5 A 8.26 4.32 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 P 0.00 4.23 0.00 2.14 1.99 0.00 3.63 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.13 0.00 7 D 9.12 4.61 0.00 2.72 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 R 8.75 3.76 0.00 1.89 1.93 0.00 3.22 0.00 0.00 3.34 7.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.77 0.00 9 E 8.31 3.99 0.00 1.97 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.36 0.00 10 K 8.07 3.95 0.00 1.74 1.82 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.33 7.81 11 A 8.52 4.23 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 L 8.49 4.04 0.00 1.83 1.84 0.94 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 13 E 8.20 3.95 0.00 2.13 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.50 0.00 14 L 7.90 4.17 0.00 1.73 1.73 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 15 A 7.54 4.03 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 M 8.28 3.95 0.00 2.08 2.29 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.61 0.00 17 A 8.49 3.99 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 Q 7.81 3.85 0.00 2.29 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.75 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 19 I 7.99 3.79 2.09 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.83 1.15 0.00 0.00 20 D 8.43 4.82 0.00 2.91 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 K 8.13 3.94 0.00 1.79 1.77 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.44 7.81 22 N 7.94 4.25 0.00 2.18 1.56 0.00 0.00 6.86 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 F 8.21 4.96 0.00 3.11 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 G 8.55 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 K 7.80 4.42 0.00 1.77 1.80 0.00 1.77 0.00 0.00 0.61 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.42 7.81 26 G 9.49 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 S 8.06 4.29 0.00 4.16 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 V 7.41 4.58 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.96 0.00 0.00 29 M 8.26 4.74 0.00 2.11 2.03 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.54 0.00 30 R 8.52 4.08 0.00 1.91 1.91 0.00 3.14 0.00 0.00 3.35 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.68 0.00 31 L 8.65 4.03 0.00 1.69 1.80 1.09 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 32 G 7.99 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 E 7.45 3.90 0.00 1.98 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 34 E 8.40 4.53 0.00 1.97 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.26 0.00 35 V 8.43 3.76 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.93 0.00 0.00 36 R 8.51 4.56 0.00 1.82 1.72 0.00 3.30 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.17 0.00 37 Q 7.97 4.36 0.00 2.01 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.99 0.00 0.00 0.00 0.00 0.00 2.29 2.39 0.00 38 P 0.00 4.41 0.00 2.17 2.09 0.00 3.75 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 39 I 7.96 4.25 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.73 0.91 0.00 0.00 40 S 8.29 4.63 0.00 3.77 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 V 8.33 5.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.97 0.00 0.00 42 I 8.62 4.36 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.88 0.92 0.00 0.00 43 P 0.00 4.67 0.00 2.01 1.97 0.00 3.57 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.09 0.00 44 T 9.66 3.82 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 45 G 7.79 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 S 7.10 4.15 0.00 2.79 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.10 3.77 1.82 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.36 0.85 0.00 0.00 48 S 8.13 4.12 0.00 4.12 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.72 4.03 0.00 1.84 1.88 0.98 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 50 D 8.72 4.33 0.00 2.86 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 V 8.13 3.63 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 1.01 0.00 0.00 52 A 8.23 4.07 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 L 8.06 4.10 0.00 1.80 1.74 0.95 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 54 G 8.63 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 I 7.17 4.46 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.87 0.91 0.00 0.00 56 G 8.41 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 G 7.72 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 L 8.07 4.41 0.00 1.63 1.60 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 59 P 0.00 4.78 0.00 2.08 2.06 0.00 3.76 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.02 0.00 60 R 8.08 4.66 0.00 1.79 2.07 0.00 3.14 0.00 0.00 3.08 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.57 0.00 61 G 9.18 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 R 7.63 4.82 0.00 1.73 1.84 0.00 3.33 0.00 0.00 3.31 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.55 0.00 63 V 8.31 4.68 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 1.09 0.00 0.00 64 I 10.01 5.13 2.01 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.59 0.95 0.00 0.00 65 E 8.97 5.12 0.00 2.14 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.39 0.00 66 I 8.83 4.92 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.82 0.92 0.00 0.00 67 Y 9.04 5.69 0.00 3.05 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 G 8.78 4.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 P 0.00 4.49 0.00 2.21 2.01 0.00 3.75 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.13 0.00 70 E 8.39 4.23 0.00 1.98 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.91 0.00 71 S 8.91 4.34 0.00 4.07 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 S 7.54 4.16 0.00 3.96 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.43 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 K 8.32 3.84 0.00 1.87 1.95 0.00 1.84 0.00 0.00 1.98 0.00 0.00 3.32 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.56 1.59 7.81 75 T 8.04 3.98 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 76 T 8.02 3.98 4.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 77 V 7.96 3.54 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 1.09 0.00 0.00 78 A 8.14 4.03 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.30 3.95 0.00 1.75 1.63 1.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 80 H 8.32 4.10 0.00 3.44 3.36 0.00 5.64 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 A 8.26 4.09 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 V 7.92 3.50 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.08 0.00 0.00 83 A 8.14 3.93 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 N 8.20 4.23 0.00 2.88 2.86 0.00 0.00 6.99 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 A 8.22 4.04 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 8.31 4.70 0.00 2.24 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.67 0.00 0.00 0.00 0.00 0.00 2.50 2.52 0.00 87 A 8.07 4.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 A 7.60 4.43 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 G 8.11 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 G 7.90 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 I 8.34 4.80 2.04 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.70 0.91 0.00 0.00 92 A 8.88 5.74 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 A 8.50 5.03 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 F 9.22 4.81 0.00 3.09 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 I 8.86 4.00 1.75 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.62 0.85 0.00 0.00 96 D 9.26 4.97 0.00 3.27 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 A 8.16 4.69 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 E 8.49 4.33 0.00 1.97 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.25 0.00 99 H 9.43 4.68 0.00 3.29 3.38 0.00 5.57 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 A 8.03 4.57 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 L 7.92 3.66 0.00 1.39 1.53 0.61 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 102 D 8.45 4.76 0.00 2.70 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 P 0.00 4.20 0.00 2.25 2.24 0.00 3.73 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.04 0.00 104 E 8.27 3.98 0.00 2.23 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.31 0.00 105 Y 8.50 4.25 0.00 3.11 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 A 7.98 3.82 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 K 8.02 4.15 0.00 1.94 1.82 0.00 1.65 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.57 1.44 7.81 108 K 7.17 3.89 0.00 1.85 1.72 0.00 1.73 0.00 0.00 2.03 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.45 7.81 109 L 7.10 4.00 0.00 1.43 1.29 0.52 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 110 G 7.61 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 V 8.04 3.87 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.88 0.00 0.00 112 D 9.68 4.81 0.00 2.70 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 T 8.23 3.85 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 114 D 8.15 4.28 0.00 2.67 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 S 7.71 4.48 0.00 4.03 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 L 7.80 4.52 0.00 1.72 1.76 0.97 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 117 L 8.43 4.29 0.00 1.66 1.59 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.34 5.04 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.94 0.00 0.00 119 S 8.98 4.74 0.00 3.95 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 Q 8.41 5.39 0.00 1.95 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.71 0.00 0.00 0.00 0.00 0.00 2.48 2.26 0.00 121 P 0.00 4.33 0.00 1.94 2.10 0.00 3.78 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.15 0.00 122 D 8.94 4.49 0.00 2.84 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 T 7.47 4.87 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 124 G 8.50 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 E 8.15 3.98 0.00 2.07 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.43 0.00 126 Q 7.95 3.92 0.00 2.11 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.68 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 127 A 8.12 4.27 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 L 8.17 3.95 0.00 1.73 1.77 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 129 E 8.27 3.91 0.00 2.37 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 130 I 8.64 3.65 2.03 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.93 0.91 0.00 0.00 131 A 8.24 3.98 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 D 8.41 4.24 0.00 2.90 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 M 8.12 4.10 0.00 2.01 2.24 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.58 0.00 134 L 8.16 4.05 0.00 1.91 1.66 0.91 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 135 V 8.11 3.51 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.97 0.00 0.00 136 R 7.74 4.13 0.00 1.93 2.00 0.00 3.10 0.00 0.00 3.28 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.58 0.00 137 S 8.03 4.45 0.00 4.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 G 8.01 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 A 7.62 4.17 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 L 7.65 4.63 0.00 1.64 1.59 0.91 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 141 D 9.13 4.79 0.00 2.63 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 I 7.48 5.05 1.86 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.58 0.91 0.00 0.00 143 I 8.79 5.01 1.80 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.35 0.82 0.00 0.00 144 V 8.57 4.62 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.98 0.00 0.00 145 I 7.98 4.26 1.46 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.10 0.93 0.00 0.00 146 D 8.39 4.49 0.00 2.30 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 S 8.65 3.94 0.00 4.26 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 V 8.73 3.49 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 1.03 0.00 0.00 149 A 8.06 3.97 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 A 8.69 4.47 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 L 7.77 4.47 0.00 1.85 1.69 1.01 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 152 V 7.93 3.81 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.94 0.00 0.00 153 P 0.00 5.06 0.00 2.15 1.98 0.00 3.88 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.01 0.00 154 R 9.01 3.81 0.00 1.89 1.92 0.00 3.24 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 155 A 8.06 4.18 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 E 7.82 4.21 0.00 1.97 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.38 0.00 157 I 7.45 3.82 2.02 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.79 0.92 0.00 0.00 158 E 8.24 4.06 0.00 1.91 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 159 G 8.72 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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4.04 0.00 1.92 1.67 0.92 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 169 Q 8.09 3.90 0.00 2.16 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.69 0.00 0.00 0.00 0.00 0.00 2.42 2.56 0.00 170 A 7.91 3.94 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 R 7.59 3.84 0.00 2.04 2.01 0.00 3.15 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.75 0.00 172 L 8.39 3.88 0.00 1.75 1.85 0.92 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 173 M 8.42 4.02 0.00 2.21 2.09 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.60 0.00 174 S 8.55 4.14 0.00 4.04 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 Q 8.65 3.97 0.00 2.01 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.39 2.62 0.00 176 A 7.93 4.05 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 L 7.45 3.62 0.00 0.78 0.50 0.66 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 178 R 7.21 3.87 0.00 1.88 2.21 0.00 3.31 0.00 0.00 3.30 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.75 0.00 179 K 7.61 4.18 0.00 2.07 2.03 0.00 1.35 0.00 0.00 1.56 0.00 0.00 3.10 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.41 7.81 180 M 7.94 4.22 0.00 2.16 2.22 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.58 0.00 181 T 8.14 4.00 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 182 G 8.11 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 A 7.68 4.03 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 L 8.59 3.98 0.00 1.92 1.77 1.01 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 185 N 7.91 4.38 0.00 2.75 3.05 0.00 0.00 7.27 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 N 8.00 4.47 0.00 2.89 2.89 0.00 0.00 7.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 S 8.52 4.34 0.00 3.97 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 G 8.46 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 T 7.47 4.73 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 190 T 9.21 4.32 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 191 A 9.62 4.81 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 I 8.30 4.59 1.79 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.61 0.92 0.00 0.00 193 F 9.51 4.83 0.00 2.88 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 I 8.67 4.51 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.51 0.97 0.00 0.00 195 N 9.17 5.08 0.00 2.95 2.85 0.00 0.00 6.56 8.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 A 8.73 5.09 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 L 8.43 4.17 0.00 1.42 1.48 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 198 R 8.72 4.38 0.00 1.77 1.80 0.00 3.26 0.00 0.00 3.26 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.15 0.00 *209 E 8.05 4.18 0.00 2.01 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.88 0.00 210 T 7.95 4.17 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 211 T 7.98 3.60 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 212 T 8.17 3.82 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 213 G 7.72 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 G 8.08 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 K 7.98 3.93 0.00 1.87 1.74 0.00 1.82 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.36 1.08 7.81 216 A 7.97 4.53 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 L 7.45 3.81 0.00 1.67 1.80 0.37 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 218 K 7.67 3.67 0.00 1.80 1.74 0.00 1.62 0.00 0.00 1.27 0.00 0.00 2.72 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.86 1.27 7.81 219 F 8.14 4.36 0.00 3.05 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 Y 7.85 4.38 0.00 2.96 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 A 8.18 4.36 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 222 S 9.00 4.52 0.00 3.83 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 223 V 7.65 4.93 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.93 0.00 0.00 224 R 8.97 5.06 0.00 1.83 1.92 0.00 3.28 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 225 L 9.15 4.73 0.00 1.43 1.49 0.93 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 226 D 8.68 3.69 0.00 2.58 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 8.05 4.20 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.96 0.00 0.00 228 R 8.52 4.68 0.00 1.88 1.64 0.00 3.13 0.00 0.00 3.09 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 229 R 8.65 4.48 0.00 1.83 1.80 0.00 3.26 0.00 0.00 3.26 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 230 I 8.63 4.61 1.84 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.80 0.90 0.00 0.00 231 E 7.96 4.70 0.00 1.63 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 1.88 0.00 232 T 8.33 4.58 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 233 L 8.10 3.89 0.00 1.83 1.64 0.94 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 234 K 8.97 4.17 0.00 1.64 1.76 0.00 1.93 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.33 0.92 7.81 235 D 8.71 4.99 0.00 2.88 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 236 G 7.44 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 237 T 8.26 4.35 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 238 D 7.57 4.42 0.00 2.82 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 239 A 8.78 4.13 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 240 V 8.03 4.36 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 1.01 0.00 0.00 241 G 7.40 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 242 N 9.24 5.44 0.00 2.71 2.74 0.00 0.00 6.97 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 243 R 8.83 4.81 0.00 1.92 1.74 0.00 3.04 0.00 0.00 3.34 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.76 0.00 244 T 8.73 4.79 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 245 R 8.54 4.53 0.00 1.71 1.64 0.00 3.03 0.00 0.00 3.24 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.50 0.00 246 V 8.65 4.73 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 1.08 0.00 0.00 247 K 8.40 4.70 0.00 1.88 1.62 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.40 1.42 7.81 248 V 8.63 4.30 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 1.00 0.00 0.00 249 V 8.13 3.71 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 1.15 0.00 0.00 250 K 7.88 4.42 0.00 1.80 1.57 0.00 1.60 0.00 0.00 1.62 0.00 0.00 2.82 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.27 1.28 7.81 251 N 8.23 5.09 0.00 2.68 2.51 0.00 0.00 7.21 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 252 K 9.81 4.31 0.00 1.73 1.81 0.00 1.63 0.00 0.00 1.62 0.00 0.00 2.84 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.55 1.57 7.81 253 V 8.05 4.39 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 1.00 0.00 0.00 254 S 7.31 4.48 0.00 3.89 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 255 P 0.00 4.34 0.00 2.08 2.05 0.00 3.71 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.07 0.00 256 P 0.00 4.37 0.00 1.20 1.75 0.00 3.61 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 1.42 0.00 257 F 9.18 4.38 0.00 3.22 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 258 K 7.69 4.50 0.00 1.90 1.77 0.00 1.81 0.00 0.00 1.85 0.00 0.00 2.89 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.58 1.51 7.81 259 Q 8.55 5.19 0.00 1.91 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.79 0.00 0.00 0.00 0.00 0.00 2.41 2.37 0.00 260 A 8.85 4.95 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 261 E 8.66 5.00 0.00 1.79 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.25 0.00 262 F 8.02 4.94 0.00 3.14 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 263 D 8.83 5.35 0.00 2.66 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 264 I 8.82 4.95 1.98 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.38 1.15 0.00 0.00 265 L 8.43 4.74 0.00 1.69 1.60 0.93 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 *266 Y 8.55 4.11 0.00 2.05 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 267 G 9.24 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 268 Q 7.68 4.67 0.00 2.12 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.71 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 269 G 7.99 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 270 I 8.60 3.90 1.70 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.58 0.66 0.00 0.00 271 S 9.00 4.13 0.00 3.86 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 272 R 8.57 3.80 0.00 1.85 1.84 0.00 3.19 0.00 0.00 3.28 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 273 E 8.25 3.97 0.00 2.05 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.43 0.00 274 G 8.54 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 275 S 8.22 4.07 0.00 4.12 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 276 L 8.31 3.75 0.00 1.77 1.62 0.86 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 277 I 8.05 3.56 1.81 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.17 0.30 0.00 0.00 278 D 8.20 4.41 0.00 2.92 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 279 M 9.11 4.16 0.00 1.93 2.09 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.57 0.00 280 G 9.09 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 281 V 8.13 4.09 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 1.18 0.00 0.00 282 E 8.16 4.02 0.00 2.15 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.63 0.00 283 H 8.16 4.50 0.00 3.58 3.72 0.00 5.93 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 284 G 8.31 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 285 F 7.30 4.26 0.00 3.12 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 286 I 7.93 4.98 2.02 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.86 1.04 0.00 0.00 287 R 9.45 4.75 0.00 1.81 1.84 0.00 3.16 0.00 0.00 3.23 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 288 K 8.48 5.27 0.00 1.42 1.70 0.00 1.87 0.00 0.00 1.78 0.00 0.00 2.79 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.34 0.84 7.81 289 S 8.62 4.07 0.00 3.87 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 290 G 8.12 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 291 S 8.89 4.18 0.00 4.23 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 292 W 7.72 4.32 0.00 3.20 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 293 F 8.64 5.59 0.00 3.10 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 294 T 9.33 5.24 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 295 Y 8.81 4.99 0.00 3.09 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 296 E 9.40 3.47 0.00 1.16 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.14 0.00 297 G 7.93 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 298 E 8.76 4.51 0.00 2.18 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 299 Q 8.65 4.49 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.88 0.00 0.00 0.00 0.00 0.00 2.51 2.97 0.00 300 L 9.94 3.28 0.00 1.97 1.57 0.72 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 301 G 7.55 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 302 Q 6.82 3.60 0.00 2.08 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.56 0.00 0.00 0.00 0.00 0.00 2.23 1.91 0.00 303 G 8.65 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 304 K 9.30 3.55 0.00 1.91 1.89 0.00 1.73 0.00 0.00 1.81 0.00 0.00 3.06 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.43 1.39 7.81 305 E 8.06 3.91 0.00 2.01 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.34 0.00 306 N 8.21 4.09 0.00 2.86 2.79 0.00 0.00 6.94 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 307 A 8.19 4.19 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 308 R 7.95 3.82 0.00 1.94 2.13 0.00 3.28 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 309 K 8.81 4.00 0.00 1.73 1.82 0.00 1.91 0.00 0.00 1.57 0.00 0.00 2.85 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.38 1.34 7.81 310 F 8.43 3.98 0.00 3.38 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 311 L 8.32 4.23 0.00 1.80 1.71 1.21 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 312 L 8.01 4.17 0.00 1.70 1.57 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 313 E 7.88 4.33 0.00 1.75 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.45 0.00 314 N 8.05 4.53 0.00 2.22 2.60 0.00 0.00 6.80 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 315 T 7.79 4.12 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 316 D 7.87 4.55 0.00 2.73 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 317 V 7.32 4.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 1.11 0.00 0.00 318 A 8.37 4.04 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 319 N 7.32 4.22 0.00 3.03 2.83 0.00 0.00 6.75 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 320 E 7.72 4.04 0.00 1.88 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 321 I 7.26 3.39 1.75 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.35 -0.02 0.61 0.00 0.00 322 E 8.47 3.75 0.00 2.03 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.25 0.00 323 K 7.78 3.92 0.00 2.10 1.88 0.00 1.55 0.00 0.00 1.62 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.50 7.81 324 K 8.19 3.83 0.00 1.45 0.87 0.00 2.01 0.00 0.00 2.16 0.00 0.00 3.15 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.55 1.67 7.81 325 I 7.76 3.52 1.79 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.18 0.80 0.00 0.00 326 K 8.60 4.12 0.00 1.71 1.82 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.37 1.35 7.81 327 E 8.07 4.26 0.00 2.23 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.59 0.00 328 K 8.12 4.18 0.00 2.16 2.18 0.00 1.84 0.00 0.00 2.06 0.00 0.00 3.02 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.64 1.62 7.81 329 L 8.26 4.45 0.00 1.80 1.45 1.06 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 330 G 6.57 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 331 I 7.97 4.64 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.88 0.91 0.00 0.00 332 G 8.67 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 333 A 8.47 4.54 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 334 V 8.29 3.72 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.93 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.